G706-0794 Screening compound: 2-benzyl-N-(propan-2-yl)-1,3-benzoxazole-6-carboxamide

G706-0794 Screening compound: 2-benzyl-N-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
G706-0794 Screening compound: 2-benzyl-N-(propan-2-yl)-1,3-benzoxazole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G706-0794
2-benzyl-N-(propan-2-yl)-1,3-benzoxazole-6-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

G706-0794

Molecular Formula

C18H18N2O2 (C18 H18 N2 O2)

Compound Name

2-benzyl-N-(propan-2-yl)-1,3-benzoxazole-6-carboxamide

IUPAC name

2-benzyl-N-(propan-2-yl)-13-benzoxazole-6-carboxamide

SMILES

CC(C)NC(c(cc1)cc2c1nc(Cc1ccccc1)o2)=O

InChI

InChI=1S/C18H18N2O2/c1-12(2)19-18(21)14-8-9-15-16(11-14)22-17(20-15)10-13-6-4-3-5-7-13/h3-9,11-12H,10H2,1-2H3,(H,19,21)

InChI Key

NDHCMBUBSRKUMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27152343

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.604

Distribution Coefficient, logD

3.604

Water Solubility, LogSw

-3.84

Polar Surface Area

40.373

Acid Dissociation Constant (pKa)

14.32

Base Dissociation Constant (pKb)

-0.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

G706-0794 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G706-0794 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G706-0794?
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What is the minimum amount of G706-0794 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G706-0794
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G706-0794
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of G706-0794 available by request